V006-1791 Screening compound: 1-(2-chlorophenyl)-4-[2-({[4-(2-chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carbonyl]piperazine

V006-1791 Screening compound: 1-(2-chlorophenyl)-4-[2-({[4-(2-chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carbonyl]piperazine
V006-1791 Screening compound: 1-(2-chlorophenyl)-4-[2-({[4-(2-chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carbonyl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound V006-1791
1-(2-chlorophenyl)-4-[2-({[4-(2-chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carbonyl]piperazine

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

V006-1791

Molecular Formula

C28H23Cl2N7OS2 (C28 H23 Cl2 N7 OS2)

Compound Name

1-(2-chlorophenyl)-4-[2-({[4-(2-chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carbonyl]piperazine

IUPAC name

n/a

SMILES

O=C(c1csc(CSc2nnc(-c3ccncc3)n2-c(cccc2)c2Cl)n1)N(CC1)CCN1c(cccc1)c1Cl

InChI

InChI=1S/C28H23Cl2N7OS2/c29-20-5-1-3-7-23(20)35-13-15-36(16-14-35)27(38)22-17-39-25(32-22)18-40-28-34-33-26(19-9-11-31-12-10-19)37(28)24-8-4-2-6-21(24)30/h1-12,17H,13-16,18H2

InChI Key

FCNNNHWATWEXNM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19736243

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

608.57

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.652

Distribution Coefficient, logD

5.652

Water Solubility, LogSw

-5.93

Polar Surface Area

63.948

Acid Dissociation Constant (pKa)

28.47

Base Dissociation Constant (pKb)

2.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.90

References: we are preparing a list of scientific research reports with V006-1791 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V006-1791?
Check Price and Availability of V006-1791, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V006-1791 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V006-1791
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V006-1791
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of V006-1791 available by request